2-[4-(4-Fluorobenzoyl)piperazine-1-carbonyl]-3-methyl-1H-indole

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Basic information

CAS: 1215764-13-8
Standard SMILES: Cc1c(C(=O)N2CCN(C(=O)c3ccc(F)cc3)CC2)[nH]c2ccccc12
InChIKey: WPIMDMOIUSYIJM-UHFFFAOYSA-N
Molecular formula: C21H20FN3O2
Average molar mass: 365.4 g/mol
Monoisotopic mass: 365.15395505

Names & identifiers

Preferred name: 2-[4-(4-Fluorobenzoyl)piperazine-1-carbonyl]-3-methyl-1H-indole
IUPAC: (4-fluorophenyl)-[4-(3-methyl-1H-indole-2-carbonyl)piperazin-1-yl]methanone

Names & synonyms

1215764-13-8[4-(4-Fluorobenzoyl)piperazin-1-yl](3-methyl-1H-indol-2-yl)methanoneDTXSID301152906(4-fluorophenyl)-[4-(3-methyl-1H-indole-2-carbonyl)piperazin-1-yl]methanone2-[4-(4-FLUOROBENZOYL)PIPERAZINE-1-CARBONYL]-3-METHYL-1H-INDOLEAKOS021876890Methanone, [4-(4-fluorobenzoyl)-1-piperazinyl](3-methyl-1H-indol-2-yl)-

Database identifiers

CAS: 1215764-13-8
PubChem CID: 53013293
DTXSID: DTXSID301152906

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 56.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 27
Formal charge: 0
Complexity: 556

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Compound notes

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